Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q8u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 HIS 3.A O no hydrogen 2.666 N/A HIS 3.A ND1 GLU 121.A OE1 no hydrogen 2.688 N/A HIS 3.A NE2 ASP 109.A OD1 no hydrogen 2.632 N/A HIS 4.A N LYS 123.A O no hydrogen 2.848 N/A LEU 12.A N LEU 234.A O no hydrogen 2.823 N/A LYS 13.A N ASP 56.A OD2 no hydrogen 2.790 N/A LYS 13.A NZ ARG 53.A O no hydrogen 3.070 N/A LYS 13.A NZ GLU 54.A O no hydrogen 3.253 N/A ILE 14.A N VAL 232.A O no hydrogen 2.799 N/A LEU 15.A N LEU 57.A O no hydrogen 2.972 N/A HIS 16.A N VAL 230.A O no hydrogen 2.979 N/A HIS 16.A ND1 TYR 191.A OH no hydrogen 2.804 N/A HIS 16.A NE2 THR 61.A OG1 no hydrogen 2.833 N/A THR 17.A N LEU 59.A O no hydrogen 2.944 N/A SER 18.A OG ASP 19.A OD2 no hydrogen 2.540 N/A SER 18.A OG THR 61.A O no hydrogen 3.021 N/A SER 18.A OG THR 61.A OG1 no hydrogen 2.970 N/A ASP 19.A N THR 61.A O no hydrogen 3.232 N/A TRP 20.A NE1 THR 17.A OG1 no hydrogen 3.067 N/A HIS 21.A N ASP 63.A O no hydrogen 2.964 N/A HIS 21.A ND1 HIS 66.A ND1 no hydrogen 2.970 N/A LEU 22.A N LEU 64.A O no hydrogen 2.787 N/A VAL 24.A N HIS 21.A O no hydrogen 3.108 N/A SER 26.A N VAL 33.A O no hydrogen 2.745 N/A SER 26.A OG ILE 218.A O no hydrogen 3.402 N/A TRP 27.A NE1 ASP 219.A OD1 no hydrogen 2.803 N/A SER 30.A N TRP 27.A O no hydrogen 2.956 N/A SER 30.A OG TRP 27.A O no hydrogen 3.281 N/A SER 30.A OG VAL 300.A O no hydrogen 2.455 N/A ARG 31.A N TRP 27.A O no hydrogen 2.761 N/A ARG 31.A NE LEU 299.A O no hydrogen 2.875 N/A ARG 31.A NH2 LEU 299.A O no hydrogen 3.090 N/A VAL 33.A N SER 26.A O no hydrogen 2.931 N/A ARG 35.A N VAL 24.A O no hydrogen 3.255 N/A ARG 35.A NE.B GLU 38.A OE1 no hydrogen 2.831 N/A ARG 35.A NH1.A SER 26.A OG no hydrogen 2.811 N/A ARG 35.A NH1.A ARG 217.A O no hydrogen 2.985 N/A ARG 35.A NH1.B SER 26.A OG no hydrogen 3.145 N/A ARG 35.A NH1.B ARG 217.A O no hydrogen 2.822 N/A ARG 35.A NH2.A GLU 38.A OE1 no hydrogen 2.934 N/A ARG 35.A NH2.A ARG 217.A O no hydrogen 3.030 N/A ARG 35.A NH2.B GLU 38.A OE1 no hydrogen 3.029 N/A ARG 35.A NH2.B GLU 38.A OE2 no hydrogen 3.467 N/A ARG 35.A NH2.B ARG 217.A O no hydrogen 2.658 N/A ARG 36.A N ASP 34.A OD1 no hydrogen 2.966 N/A ARG 36.A NE ASP 78.A OD2 no hydrogen 2.761 N/A ARG 36.A NH2 ASP 78.A OD1 no hydrogen 3.007 N/A LEU 39.A N ARG 35.A O no hydrogen 2.911 N/A LYS 40.A N ARG 36.A O no hydrogen 2.847 N/A LYS 40.A NZ TYR 82.A OH no hydrogen 3.086 N/A LYS 41.A N GLU 37.A O no hydrogen 3.073 N/A ALA 42.A N GLU 38.A O no hydrogen 3.049 N/A LEU 43.A N LEU 39.A O no hydrogen 2.864 N/A ASP 44.A N LYS 40.A O no hydrogen 2.900 N/A LYS 45.A N LYS 41.A O no hydrogen 3.200 N/A LYS 45.A NZ ASP 246.A O no hydrogen 3.226 N/A LYS 45.A NZ SER 248.A OG no hydrogen 2.898 N/A VAL 46.A N ALA 42.A O no hydrogen 3.027 N/A VAL 47.A N LEU 43.A O no hydrogen 2.812 N/A GLU 48.A N ASP 44.A O no hydrogen 2.925 N/A GLU 49.A N LYS 45.A O no hydrogen 3.050 N/A ALA 50.A N VAL 46.A O no hydrogen 3.092 N/A GLU 51.A N VAL 47.A O no hydrogen 3.052 N/A LYS 52.A N GLU 48.A O no hydrogen 2.722 N/A LYS 52.A NZ GLU 49.A OE2 no hydrogen 2.700 N/A ARG 53.A N GLU 49.A O no hydrogen 2.780 N/A ARG 53.A NE GLU 49.A OE1 no hydrogen 2.623 N/A ARG 53.A NH1 GLU 243.A OE1 no hydrogen 3.423 N/A ARG 53.A NH2 GLU 243.A OE1 no hydrogen 3.458 N/A GLU 54.A N GLU 51.A O no hydrogen 3.103 N/A VAL 55.A N ALA 50.A O no hydrogen 3.470 N/A ASP 56.A N LYS 13.A O no hydrogen 2.802 N/A LEU 57.A N LYS 13.A O no hydrogen 3.178 N/A ILE 58.A N PRO 89.A O no hydrogen 2.804 N/A LEU 59.A N LEU 15.A O no hydrogen 2.761 N/A LEU 60.A N VAL 91.A O no hydrogen 2.990 N/A THR 61.A N THR 17.A O no hydrogen 3.295 N/A THR 61.A OG1 HIS 16.A NE2 no hydrogen 2.833 N/A THR 61.A OG1 SER 18.A OG no hydrogen 2.970 N/A THR 61.A OG1 LEU 194.A O no hydrogen 3.186 N/A ASP 63.A N ASP 19.A OD1 no hydrogen 3.339 N/A HIS 66.A N LEU 22.A O no hydrogen 2.929 N/A HIS 66.A ND1 HIS 21.A ND1 no hydrogen 2.970 N/A ASN 70.A N SER 67.A OG no hydrogen 3.183 N/A ALA 75.A N SER 72.A OG no hydrogen 3.183 N/A LEU 76.A N SER 72.A O no hydrogen 3.012 N/A HIS 77.A N VAL 73.A O no hydrogen 2.781 N/A ASP 78.A N VAL 74.A O no hydrogen 2.785 N/A LEU 79.A N ALA 75.A O no hydrogen 2.916 N/A LEU 80.A N LEU 76.A O no hydrogen 3.061 N/A ASP 81.A N HIS 77.A O no hydrogen 2.895 N/A TYR 82.A N ASP 78.A O no hydrogen 2.916 N/A TYR 82.A OH ASP 44.A OD1 no hydrogen 2.498 N/A LEU 83.A N LEU 79.A O no hydrogen 2.843 N/A LYS 84.A N LEU 80.A O no hydrogen 3.023 N/A ARG 85.A N ASP 81.A O no hydrogen 3.089 N/A ARG 85.A NE ASP 81.A OD1 no hydrogen 3.129 N/A ARG 85.A NH2 ASP 81.A OD2 no hydrogen 3.111 N/A VAL 90.A N ASP 109.A O no hydrogen 2.972 N/A VAL 91.A N ILE 58.A O no hydrogen 2.939 N/A VAL 92.A N THR 111.A O no hydrogen 2.810 N/A LEU 93.A N LEU 60.A O no hydrogen 2.929 N/A GLY 100.A N LEU 96.A O no hydrogen 3.217 N/A ASN 101.A N LYS 97.A O no hydrogen 2.982 N/A PHE 102.A N LEU 98.A O no hydrogen 3.107 N/A VAL 103.A N PHE 99.A O no hydrogen 2.976 N/A THR 104.A N GLY 100.A O no hydrogen 3.171 N/A THR 104.A OG1 GLY 100.A O no hydrogen 2.776 N/A SER 105.A N ASN 101.A O no hydrogen 3.247 N/A SER 105.A N PHE 102.A O no hydrogen 3.113 N/A SER 105.A OG ASN 101.A O no hydrogen 3.026 N/A ILE 106.A N PHE 102.A O no hydrogen 3.243 N/A ILE 106.A N VAL 103.A O no hydrogen 3.277 N/A ASP 109.A N SER 107.A OG no hydrogen 3.141 N/A THR 111.A N VAL 90.A O no hydrogen 2.957 N/A PHE 112.A N THR 104.A OG1 no hydrogen 2.984 N/A VAL 113.A N VAL 92.A O no hydrogen 2.772 N/A GLU 116.A N SER 114.A OG no hydrogen 3.103 N/A VAL 118.A N ILE 130.A O no hydrogen 3.162 N/A VAL 120.A N VAL 128.A O no hydrogen 2.854 N/A ALA 122.A N GLN 126.A O no hydrogen 2.967 N/A LYS 123.A N ASP 56.A O no hydrogen 2.965 N/A LYS 123.A NZ HIS 1.A O no hydrogen 3.443 N/A ARG 124.A N GLN 126.A OE1 no hydrogen 3.060 N/A ARG 124.A NE ASP 56.A OD1 no hydrogen 2.891 N/A ARG 124.A NH2 ASP 56.A OD2 no hydrogen 2.921 N/A GLY 125.A N ALA 122.A O no hydrogen 2.911 N/A GLN 126.A N GLN 126.A OE1 no hydrogen 2.919 N/A GLN 126.A NE2 GLU 11.A O no hydrogen 2.664 N/A LYS 127.A N ASP 162.A OD2 no hydrogen 3.301 N/A VAL 128.A N VAL 120.A O no hydrogen 2.884 N/A ARG 129.A N PHE 163.A O no hydrogen 2.898 N/A ARG 129.A NE ASP 119.A OD1 no hydrogen 3.432 N/A ARG 129.A NE ASP 119.A OD2 no hydrogen 3.471 N/A ARG 129.A NH1 GLU 156.A O no hydrogen 2.821 N/A ARG 129.A NH1 GLU 156.A OE1.B no hydrogen 3.145 N/A ARG 129.A NH2 ASP 119.A OD2 no hydrogen 3.169 N/A ILE 130.A N VAL 118.A O no hydrogen 2.820 N/A LEU 131.A N ILE 165.A O no hydrogen 2.751 N/A PHE 145.A N ASP 141.A O no hydrogen 2.945 N/A LEU 146.A N PHE 142.A O no hydrogen 2.980 N/A GLU 147.A N ARG 143.A O no hydrogen 2.977 N/A SER 148.A N PHE 144.A O no hydrogen 2.916 N/A SER 148.A OG.A PHE 145.A O no hydrogen 2.633 N/A SER 148.A OG.B PHE 144.A O no hydrogen 2.552 N/A ARG 149.A N PHE 145.A O no hydrogen 2.987 N/A LEU 150.A N LEU 146.A O no hydrogen 3.064 N/A ASN 151.A N GLU 147.A O no hydrogen 3.088 N/A LYS 152.A N SER 148.A O no hydrogen 3.054 N/A LYS 152.A NZ GLU 116.A OE1 no hydrogen 3.056 N/A LYS 152.A NZ GLU 156.A OE1.A no hydrogen 3.483 N/A LYS 152.A NZ GLU 156.A OE2.A no hydrogen 2.614 N/A LEU 153.A N ARG 149.A O no hydrogen 3.112 N/A TYR 154.A N LEU 150.A O no hydrogen 2.946 N/A GLU 155.A N ASN 151.A O no hydrogen 3.186 N/A GLU 156.A N LYS 152.A O no hydrogen 2.917 N/A ALA 157.A N LEU 153.A O no hydrogen 2.852 N/A LEU 158.A N TYR 154.A O no hydrogen 3.122 N/A LYS 159.A N GLU 156.A O no hydrogen 3.080 N/A LYS 159.A NZ GLU 156.A OE1.B no hydrogen 2.928 N/A LYS 160.A N ALA 157.A O no hydrogen 3.246 N/A LYS 160.A NZ ASP 190.A OD1 no hydrogen 3.193 N/A LYS 160.A NZ ASP 190.A OD2 no hydrogen 3.113 N/A PHE 163.A N LYS 127.A O no hydrogen 3.263 N/A ALA 164.A N ASP 190.A OD2 no hydrogen 2.867 N/A ILE 165.A N ARG 129.A O no hydrogen 2.734 N/A PHE 166.A N TYR 191.A O no hydrogen 3.003 N/A HIS 168.A N PHE 133.A O no hydrogen 3.048 N/A THR 170.A N ILE 178.A O no hydrogen 2.805 N/A THR 170.A OG1 GLU 177.A OE2 no hydrogen 2.921 N/A VAL 171.A N TYR 211.A OH no hydrogen 3.025 N/A GLU 172.A N ILE 180.A O no hydrogen 2.866 N/A ILE 180.A N THR 170.A O no hydrogen 3.018 N/A ASN 181.A ND2 GLU 172.A OE1 no hydrogen 2.580 N/A ARG 182.A NE GLN 204.A OE1 no hydrogen 3.101 N/A ARG 182.A NH2 GLN 204.A OE1 no hydrogen 3.425 N/A ALA 183.A N ASN 181.A OD1 no hydrogen 3.080 N/A LEU 184.A N ASN 181.A O no hydrogen 2.775 N/A ILE 185.A N ARG 182.A O no hydrogen 3.259 N/A VAL 189.A N PRO 186.A O no hydrogen 3.509 N/A ASP 190.A N ALA 164.A O no hydrogen 2.923 N/A TYR 191.A OH HIS 16.A ND1 no hydrogen 2.804 N/A ALA 192.A N LEU 208.A O no hydrogen 2.824 N/A ALA 193.A N PHE 166.A O no hydrogen 2.761 N/A LEU 194.A N ILE 210.A O no hydrogen 2.969 N/A GLY 195.A N GLY 167.A O no hydrogen 3.058 N/A HIS 196.A N ASP 19.A OD2 no hydrogen 2.888 N/A HIS 198.A ND1 GLU 222.A OE2 no hydrogen 2.971 N/A SER 199.A OG ASP 225.A OD1 no hydrogen 3.020 N/A SER 199.A OG ASP 225.A OD2 no hydrogen 2.550 N/A ARG 201.A N TYR 211.A O no hydrogen 3.042 N/A ILE 203.A N THR 209.A O no hydrogen 2.878 N/A GLN 204.A NE2 ARG 182.A O no hydrogen 3.111 N/A GLN 204.A NE2 THR 209.A OG1 no hydrogen 3.222 N/A THR 209.A N GLN 204.A O no hydrogen 2.896 N/A THR 209.A OG1 PRO 207.A O no hydrogen 2.627 N/A ILE 210.A N ALA 192.A O no hydrogen 3.062 N/A TYR 211.A N ARG 201.A O no hydrogen 3.043 N/A TYR 211.A OH PHE 169.A O no hydrogen 2.489 N/A SER 214.A N HIS 198.A O no hydrogen 2.768 N/A SER 214.A OG HIS 198.A O no hydrogen 3.184 N/A SER 214.A OG ILE 216.A O no hydrogen 2.644 N/A SER 214.A OG GLU 222.A OE1 no hydrogen 3.286 N/A ARG 217.A NE GLU 222.A O no hydrogen 3.240 N/A ARG 217.A NH1 LEU 250.A O no hydrogen 3.350 N/A ARG 217.A NH2 ASP 225.A O no hydrogen 2.685 N/A ILE 218.A N GLU 222.A OE1 no hydrogen 3.150 N/A PHE 220.A N ASP 219.A OD1 no hydrogen 2.666 N/A GLU 222.A N ASP 219.A O no hydrogen 2.844 N/A ASP 225.A N GLU 222.A O no hydrogen 3.461 N/A LYS 227.A NZ HIS 198.A O no hydrogen 2.737 N/A LYS 227.A NZ SER 214.A OG no hydrogen 2.847 N/A LYS 227.A NZ GLU 222.A OE1 no hydrogen 2.574 N/A LYS 227.A NZ ASP 225.A OD2 no hydrogen 2.630 N/A ALA 229.A N ILE 245.A O no hydrogen 2.792 N/A VAL 230.A N HIS 16.A O no hydrogen 3.018 N/A PHE 231.A N GLU 243.A O no hydrogen 2.729 N/A VAL 232.A N ILE 14.A O no hydrogen 2.851 N/A GLU 233.A N ARG 241.A O no hydrogen 2.825 N/A LEU 234.A N LEU 12.A O no hydrogen 2.819 N/A ARG 236.A N LYS 10.A O no hydrogen 2.983 N/A ARG 236.A NH2 ASP 162.A OD1 no hydrogen 3.548 N/A GLU 238.A N LYS 235.A O no hydrogen 2.974 N/A ARG 241.A N GLU 233.A O no hydrogen 3.121 N/A TYR 242.A OH GLU 202.A OE1 no hydrogen 2.539 N/A GLU 243.A N PHE 231.A O no hydrogen 2.741 N/A ARG 244.A NH2 ASP 246.A OD1 no hydrogen 3.475 N/A ILE 245.A N ALA 229.A O no hydrogen 2.949 N/A ALA 247.A N LYS 227.A O no hydrogen 2.869 N/A SER 248.A N ASP 246.A OD2 no hydrogen 2.876 N/A SER 248.A OG ASP 246.A OD2 no hydrogen 3.190 N/A LEU 250.A N GLU 38.A OE2 no hydrogen 2.994 N/A LYS 253.A N TYR 278.A O no hydrogen 2.897 N/A THR 254.A N GLU 223.A OE1 no hydrogen 3.248 N/A THR 254.A OG1 GLU 223.A OE2 no hydrogen 2.425 N/A LEU 255.A N ARG 280.A O no hydrogen 2.683 N/A TYR 257.A N VAL 282.A O no hydrogen 2.900 N/A TYR 257.A OH SER 267.A OG no hydrogen 2.503 N/A ALA 264.A N ASP 261.A OD1 no hydrogen 2.934 N/A LEU 265.A N ASP 261.A O no hydrogen 2.862 N/A LYS 266.A N THR 262.A O no hydrogen 3.351 N/A LYS 266.A NZ ASP 270.A OD1 no hydrogen 3.507 N/A LYS 266.A NZ ASP 270.A OD2 no hydrogen 3.057 N/A SER 267.A N SER 263.A O no hydrogen 2.913 N/A SER 267.A OG TYR 257.A OH no hydrogen 2.503 N/A ILE 268.A N ALA 264.A O no hydrogen 3.029 N/A ARG 269.A N LEU 265.A O no hydrogen 3.012 N/A ARG 269.A NE GLU 295.A OE1 no hydrogen 3.180 N/A ARG 269.A NH2 GLU 295.A OE1 no hydrogen 3.087 N/A ASP 270.A N LYS 266.A O no hydrogen 2.921 N/A PHE 271.A N SER 267.A O no hydrogen 3.105 N/A CYS 272.A N ILE 268.A O no hydrogen 3.019 N/A CYS 272.A SG ILE 268.A O no hydrogen 3.172 N/A ARG 273.A N ARG 269.A O no hydrogen 3.132 N/A ARG 273.A NH1 ASP 270.A OD1 no hydrogen 3.326 N/A ARG 273.A NH2 ASP 270.A OD1 no hydrogen 2.928 N/A PHE 275.A N CYS 272.A O no hydrogen 3.033 N/A TYR 278.A N PRO 251.A O no hydrogen 3.213 N/A VAL 279.A N ASN 298.A O no hydrogen 2.992 N/A ARG 280.A N LYS 253.A O no hydrogen 2.813 N/A ARG 280.A NE THR 254.A OG1 no hydrogen 3.044 N/A ARG 280.A NH2 THR 254.A OG1 no hydrogen 3.172 N/A VAL 281.A N LYS 301.A O no hydrogen 2.873 N/A VAL 282.A N LEU 255.A O no hydrogen 2.837 N/A TYR 283.A N GLU 303.A OE2 no hydrogen 3.266 N/A TYR 283.A OH ASP 286.A OD1 no hydrogen 2.500 N/A GLU 284.A N LYS 258.A O no hydrogen 2.984 N/A GLU 285.A N LYS 258.A O no hydrogen 3.014 N/A LEU 293.A N PRO 291.A O no hydrogen 2.808 N/A GLU 295.A N ASP 292.A O no hydrogen 3.015 N/A ILE 296.A N LEU 293.A O no hydrogen 2.747 N/A ASN 298.A ND2.A PHE 275.A O no hydrogen 2.538 N/A ASN 298.A ND2.B CYS 272.A O no hydrogen 3.099 N/A ASN 298.A ND2.B PHE 275.A O no hydrogen 2.966 N/A ASN 298.A ND2.B GLY 277.A O no hydrogen 3.367 N/A LEU 299.A N ILE 296.A O no hydrogen 3.419 N/A VAL 300.A N VAL 279.A O no hydrogen 2.999 N/A